Literature DB >> 12546533

Windows-based guided data capture software for mass-scale thermophysical and thermochemical property data collection.

Vladimir V Diky1, Robert D Chirico, Randolph C Wilhoit, Qian Dong, Michael Frenkel.   

Abstract

Guided data capture software (GDC) is described for mass-scale abstraction from the literature of experimental thermophysical and thermochemical property data for organic chemical systems involving one, two, and three components, chemical reactions, and chemical equilibria. Property values are captured with a strictly hierarchical system based upon rigorous application of the thermodynamic constraints of the Gibbs phase rule with full traceability to source documents. Key features of the program and its adherence to scientific principles are described with particular emphasis on data-quality issues, both in terms of data accuracy and database integrity.

Year:  2003        PMID: 12546533     DOI: 10.1021/ci025534t

Source DB:  PubMed          Journal:  J Chem Inf Comput Sci        ISSN: 0095-2338


  2 in total

1.  Web Thermo Tables - an On-Line Version of the TRC Thermodynamic Tables.

Authors:  Andrei Kazakov; Chris D Muzny; Robert D Chirico; Vladimir V Diky; Michael Frenkel
Journal:  J Res Natl Inst Stand Technol       Date:  2008-08-01

2.  NIST Gas Hydrate Research Database and Web Dissemination Channel.

Authors:  K Kroenlein; C D Muzny; A Kazakov; V V Diky; R D Chirico; M Frenkel; E D Sloan
Journal:  J Res Natl Inst Stand Technol       Date:  2010-04-01
  2 in total

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